5-(1-phenyltridecylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(1-phenyltridecylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(1-phenyltridecylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(1-phenyltridecylthio)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(1-phenyltridecylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(1-phenyltridecylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C21H33N3S2 MolecularWeight: 391.63682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1=CC=CC=C1)SC2=NN=C(S2)N

Isomeric SMILES

CCCCCCCCCCCCC(C1=CC=CC=C1)SC2=NN=C(S2)N

InChI

InChI=1S/C21H33N3S2/c1-2-3-4-5-6-7-8-9-10-14-17-19(18-15-12-11-13-16-18)25-21-24-23-20(22)26-21/h11-13,15-16,19H,2-10,14,17H2,1H3,(H2,22,23)